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Workflow solutions for mass-spectrometry based non-target analysis.

Results 20 patRoon issues
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Hi @rhelmus, I am experiencing a memory usage issue when running the `generateMSPeakLists()` command: `mslists

Hi, I hope I can get some help with this. I've been trying to run Non-target screening of predicted TPs. when I run this part of the code adapted from...

Hi, I am just trying to follow the patRoon tutorial and keep getting the following error (below) when I run "findFeatures" with the patRoon example data. Have I loaded something...

`patRoon 1.2.0` As part of my analysis, I was getting random errors while executing this line: ``` formulas

patRoon 1.2.0 xcms 3.8.2 Hi Rick I was analysing 350 samples (~70GB) w/ xcms3. During feature grouping (method: PeakDensity) I received this error message: Error in result_bind(res@ptr, params): long vectors...

Hi again, this time for a feature suggestion rather than a bug: It would be nice to also to be able to sweep/optimize the xcms3 MergeNeighboringPeaksParam() parameters of the refineChromPeaks()...

Hi Rick, I have another issue. I suggest to rename the filter function of patRoon. The naming interferes with the tidyverse filter function and causes errors, if not called explicitly....

Hi, first off, thanks for your nice code package, I switched over after having some issues with IPO. The comparatively verbose output is particularly useful! This made me notice an...

Hi Rick, I was trying to visualize the results of different feature finding approaches with `plotVenn()` but got an error I don't understand: ```r > comp = comparison(fGroupsPO, fGroupsXCMS, groupAlgo="xcms3")...

Hi Rick, do you think it is possible to reduce the size of the cache file during filling of the cache? It blows up quite quickly and clutters my harddrive....